(4,4-dimethyl-1-sulfanylidene-1,4,8,9-tetrahydro-5H-[1,4]dioxino[2,3-g][1,2]dithiolo[3,4-c]quinolin-5-yl)(2-fluorophenyl)methanone
Chemical Structure Depiction of
(4,4-dimethyl-1-sulfanylidene-1,4,8,9-tetrahydro-5H-[1,4]dioxino[2,3-g][1,2]dithiolo[3,4-c]quinolin-5-yl)(2-fluorophenyl)methanone
(4,4-dimethyl-1-sulfanylidene-1,4,8,9-tetrahydro-5H-[1,4]dioxino[2,3-g][1,2]dithiolo[3,4-c]quinolin-5-yl)(2-fluorophenyl)methanone
Compound characteristics
| Compound ID: | Y021-2415 |
| Compound Name: | (4,4-dimethyl-1-sulfanylidene-1,4,8,9-tetrahydro-5H-[1,4]dioxino[2,3-g][1,2]dithiolo[3,4-c]quinolin-5-yl)(2-fluorophenyl)methanone |
| Molecular Weight: | 445.55 |
| Molecular Formula: | C21 H16 F N O3 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cc3c(cc2N1C(c1ccccc1F)=O)OCCO3 |
| Stereo: | ACHIRAL |
| logP: | 3.6143 |
| logD: | 3.6143 |
| logSw: | -3.9515 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 30.2575 |
| InChI Key: | JYUMOVZDLUKGQP-UHFFFAOYSA-N |